2-({5-[(4-tert-butylphenoxy)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-({5-[(4-tert-butylphenoxy)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
2-({5-[(4-tert-butylphenoxy)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
Compound characteristics
Compound ID: | 8013-7911 |
Compound Name: | 2-({5-[(4-tert-butylphenoxy)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide |
Molecular Weight: | 500.66 |
Molecular Formula: | C29 H32 N4 O2 S |
Smiles: | Cc1cccc(c1)NC(CSc1nnc(COc2ccc(cc2)C(C)(C)C)n1c1cccc(C)c1)=O |
Stereo: | ACHIRAL |
logP: | 6.8278 |
logD: | 6.8278 |
logSw: | -5.5923 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.337 |
InChI Key: | SBQXSUVIVQISQD-UHFFFAOYSA-N |